MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: 1UN
Name: 2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL SULFANYL-BUTYL]-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID TERT-BUTYLAMIDE
SMILES: Cc1c(cccc1O)C(=O)NC(CSc2ccccc2)C(CN3CC4CCCCC4CC3C(=O)NC(C)
(C)C)O

[show PDB table]

MMsINC molecules which have a Tanimoto coefficient superior or equal to 0.70

Neutral Molecules: 4487Ionic States: 3093Tautomers: 740Drug Similarity: 45

Items found 1 - 20 of 4487

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MMs03082412 tanimoto score: 1	MMs03082410 tanimoto score: 1	MMs00034332 tanimoto score: 0.83	MMs00029457 tanimoto score: 0.81
MMs00034330 tanimoto score: 0.8	MMs02074814 tanimoto score: 0.8	MMs02074812 tanimoto score: 0.8	MMs03428800 tanimoto score: 0.79
MMs00028018 tanimoto score: 0.79	MMs03860497 tanimoto score: 0.79	MMs03428804 tanimoto score: 0.79	MMs00030191 tanimoto score: 0.79
MMs03860481 tanimoto score: 0.79	MMs00027974 tanimoto score: 0.79	MMs00026987 tanimoto score: 0.78	MMs00030181 tanimoto score: 0.78
MMs00034331 tanimoto score: 0.78	MMs01611504 tanimoto score: 0.78	MMs00027957 tanimoto score: 0.78	MMs00027017 tanimoto score: 0.78

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